# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38908702
_cell_length_b   8.67313445
_cell_length_c   45.68300458
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.70517634
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu64
_cell_volume   1682.0594615
_cell_formula_units_Z   64
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Cu  Cu1  1  0.835265  0.774058  0.281002  1
  Cu  Cu2  1  0.608810  0.013116  0.286926  1
  Cu  Cu3  1  0.073014  0.256976  0.293488  1
  Cu  Cu4  1  0.539914  0.502015  0.299508  1
  Cu  Cu5  1  0.317587  0.744254  0.306562  1
  Cu  Cu6  1  0.101350  0.992126  0.313957  1
  Cu  Cu7  1  0.562131  0.235707  0.320398  1
  Cu  Cu8  1  0.025068  0.480328  0.326716  1
  Cu  Cu9  1  0.805617  0.723675  0.334694  1
  Cu  Cu10  1  0.589393  0.967211  0.341227  1
  Cu  Cu11  1  0.048980  0.212885  0.348147  1
  Cu  Cu12  1  0.510392  0.456672  0.354701  1
  Cu  Cu13  1  0.293630  0.700603  0.361948  1
  Cu  Cu14  1  0.078280  0.945372  0.369072  1
  Cu  Cu15  1  0.537360  0.189492  0.375775  1
  Cu  Cu16  1  0.997909  0.434095  0.382546  1
  Cu  Cu17  1  0.781689  0.677818  0.389919  1
  Cu  Cu18  1  0.566135  0.922210  0.396836  1
  Cu  Cu19  1  0.025597  0.166839  0.403727  1
  Cu  Cu20  1  0.485895  0.410880  0.410535  1
  Cu  Cu21  1  0.269898  0.655051  0.417669  1
  Cu  Cu22  1  0.054307  0.899460  0.424704  1
  Cu  Cu23  1  0.513992  0.143816  0.431549  1
  Cu  Cu24  1  0.974187  0.388183  0.438437  1
  Cu  Cu25  1  0.758156  0.632227  0.445554  1
  Cu  Cu26  1  0.542509  0.876566  0.452528  1
  Cu  Cu27  1  1.002380  0.120990  0.459428  1
  Cu  Cu28  1  0.462510  0.365231  0.466336  1
  Cu  Cu29  1  0.246572  0.609433  0.473396  1
  Cu  Cu30  1  0.030804  0.853717  0.480386  1
  Cu  Cu31  1  0.490818  0.098088  0.487280  1
  Cu  Cu32  1  0.950939  0.342415  0.494211  1
  Cu  Cu33  1  0.734962  0.586562  0.501271  1
  Cu  Cu34  1  0.519143  0.830860  0.508242  1
  Cu  Cu35  1  0.979267  0.075218  0.515137  1
  Cu  Cu36  1  0.439359  0.319539  0.522088  1
  Cu  Cu37  1  0.223431  0.563752  0.529140  1
  Cu  Cu38  1  0.007453  0.807949  0.536101  1
  Cu  Cu39  1  0.467728  0.052374  0.542994  1
  Cu  Cu40  1  0.927838  0.296728  0.549930  1
  Cu  Cu41  1  0.711770  0.540817  0.557037  1
  Cu  Cu42  1  0.495762  0.785126  0.563983  1
  Cu  Cu43  1  0.956187  0.029443  0.570828  1
  Cu  Cu44  1  0.416220  0.273911  0.577816  1
  Cu  Cu45  1  0.200261  0.518113  0.584919  1
  Cu  Cu46  1  0.983853  0.762067  0.591834  1
  Cu  Cu47  1  0.444601  0.006698  0.598689  1
  Cu  Cu48  1  0.904652  0.251101  0.605562  1
  Cu  Cu49  1  0.688276  0.494969  0.612909  1
  Cu  Cu50  1  0.471964  0.739416  0.619788  1
  Cu  Cu51  1  0.932939  0.983426  0.626486  1
  Cu  Cu52  1  0.392917  0.228300  0.633535  1
  Cu  Cu53  1  0.176851  0.472314  0.640693  1
  Cu  Cu54  1  0.959527  0.715991  0.647508  1
  Cu  Cu55  1  0.421216  0.961630  0.654281  1
  Cu  Cu56  1  0.882159  0.205280  0.660776  1
  Cu  Cu57  1  0.665078  0.448261  0.668678  1
  Cu  Cu58  1  0.445093  0.693296  0.675205  1
  Cu  Cu59  1  0.908920  0.937244  0.681702  1
  Cu  Cu60  1  0.370215  0.183875  0.688914  1
  Cu  Cu61  1  0.152920  0.427570  0.695824  1
  Cu  Cu62  1  0.931410  0.670991  0.702190  1
  Cu  Cu63  1  0.394827  0.914448  0.708560  1
  Cu  Cu64  1  0.853244  0.156989  0.714427  1
